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Herb Integrative Database
Traditional Medicine Data Platform
Ingredients

St069309

C16H15NO4

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Entity Type
Ingredients
Relation Groups
4
Relation Preview
26

Basic Information

Grouped by core information, identifiers, and descriptions.

Core Information

Name
St069309
Molecular Formula
C16H15NO4
Molecular Weight
No data
Canonical SMILES
C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1
Isomeric SMILES
C1CC2=C3C(=C4C(=C2)C=C(C(=O)O4)C(=O)O)CCCN3C1
InChI
InChI=1S/C16H15NO4/c18-15(19)12-8-10-7-9-3-1-5-17-6-2-4-11(13(9)17)14(10)21-16(12)20/h7-8H,1-6H2,(H,18,19)
Oral Bioavailability
24.017
Drug Likeness
0.813
DL Score
No data
Caco-2 Permeability
No data
ALogP
No data
Bioavailability Score
No data

Identifiers

InChI Key
No data
PubChem CID
No data

Description and Extensions

Toxicity Information
No data
Related

Related Entities

Direct relations and traceable candidates grouped by relation type.

Source HerbsActive TargetsRelated CellsRelated Tissues

Active Targets

ingredient target8 Targets
GraphMore Targets
01
ACHE
acetylcholinesterase (Cartwright blood group)
acetylcholinesterase (Cartwright blood group)
DetailsGraph